3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]-N-propan-2-yl-propanamide

Systemtic Name: 3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]-N-propan-2-yl-propanamide Openeye Name: N-isopropyl-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide CAS Name: 3-[2-nitro-4-(trifluoromethyl)anilino]-N-propan-2-ylpropanamide IUPAC Name: 3-[2-nitro-4-(trifluoromethyl)anilino]-N-propan-2-ylpropanamide Traditional Name: N-isopropyl-3-[2-nitro-4-(trifluoromethyl)anilino]propionamide Formula: C13H16F3N3O3 MolecularWeight: 319.27965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CCNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CCNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H16F3N3O3/c1-8(2)18-12(20)5-6-17-10-4-3-9(13(14,15)16)7-11(10)19(21)22/h3-4,7-8,17H,5-6H2,1-2H3,(H,18,20)